CC(C)S(=O)(=O)NCC(C)(F)c1ccc(-c2cccc(N)c2)cc1
名称: N-[2-[4-(3-aminophenyl)phenyl]-2-fluoropropyl]propane-2-sulfonamide
SMILES: CC(C)S(=O)(=O)NCC(C)(F)c1ccc(-c2cccc(N)c2)cc1

Molecular Processing

Molecular formula
C18H23FN2O2S
Molecular weight
350.46
Exact mass
350.1464
XLogP
3.45
TPSA
72.19
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
96.81

Supplementary Information

InChIKey: JFKBJNURVJGXEJ-UHFFFAOYSA-N
同義語
SCHEMBL5187248JFKBJNURVJGXEJ-UHFFFAOYSA-N{2-[4-(3-aminophenyl)phenyl]-2-fluoropropyl}[(methylethyl)sulfonyl]amine
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